N-propyl-1-pyridin-3-yldecan-2-amine

C18H32N2 — CID 63416378

IUPACN-propyl-1-pyridin-3-yldecan-2-amine
SMILESCCCCCCCCC(Cc1cccnc1)NCCC
InChIInChI=1S/C18H32N2/c1-3-5-6-7-8-9-12-18(20-13-4-2)15-17-11-10-14-19-16-17/h10-11,14,16,18,20H,3-9,12-13,15H2,1-2H3
InChIKeyBDJPQUPAIQRWNP-UHFFFAOYSA-N
MW276.47 g/mol
LogP4.74
Rot. Bonds12

About N-propyl-1-pyridin-3-yldecan-2-amine

N-propyl-1-pyridin-3-yldecan-2-amine (PubChem CID 63416378) has the molecular formula C18H32N2 and a molecular weight of 276.47 g/mol. Its IUPAC name is N-propyl-1-pyridin-3-yldecan-2-amine.

Molecular Properties

Compound NameN-propyl-1-pyridin-3-yldecan-2-amine
PubChem CID63416378
Molecular FormulaC18H32N2
Molecular Weight276.47 g/mol
Exact Mass276.26
IUPAC NameN-propyl-1-pyridin-3-yldecan-2-amine
SMILESCCCCCCCCC(Cc1cccnc1)NCCC
InChIInChI=1S/C18H32N2/c1-3-5-6-7-8-9-12-18(20-13-4-2)15-17-11-10-14-19-16-17/h10-11,14,16,18,20H,3-9,12-13,15H2,1-2H3
InChIKeyBDJPQUPAIQRWNP-UHFFFAOYSA-N
XLogP4.74
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.47
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-propyl-1-pyridin-3-ylnon-8-en-2-amine
CID 107009001
N-methyl-1-pyridin-3-yldodecan-2-amine
CID 63416247
5,5,5-trifluoro-N-propyl-1-pyridin-3-ylpentan-2-amine
CID 64565788
N-propyl-1-pyridin-3-yl-4-pyridin-4-ylbutan-2-amine
CID 105179991
3-(2-hexyloctyl)pyridine
CID 167277838
4-(2-methylphenyl)-N-propyl-1-pyridin-3-ylbutan-2-amine
CID 105180056
1-pyridin-3-ylundecan-2-amine
CID 62603230
1-(5-bromo-3-pyridinyl)-N-propyldecan-2-amine
CID 105036606
N-ethyl-1-pyridin-3-yldecan-3-amine
CID 105125052
1-(4-fluorophenyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 62551911
1-(4-ethylphenyl)-N-propylnonan-2-amine
CID 115803240
1-(2,6-difluorophenyl)-N-propyl-3-pyridin-3-ylpropan-2-amine
CID 114931955

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-pyridin-3-yldecan-2-amine?
The IUPAC name of N-propyl-1-pyridin-3-yldecan-2-amine (CID 63416378) is N-propyl-1-pyridin-3-yldecan-2-amine.
What is the SMILES notation for N-propyl-1-pyridin-3-yldecan-2-amine?
The canonical SMILES for N-propyl-1-pyridin-3-yldecan-2-amine is CCCCCCCCC(Cc1cccnc1)NCCC.
What is the InChIKey of N-propyl-1-pyridin-3-yldecan-2-amine?
The InChIKey is BDJPQUPAIQRWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2/c1-3-5-6-7-8-9-12-18(20-13-4-2)15-17-11-10-14-19-16-17/h10-11,14,16,18,20H,3-9,12-13,15H2,1-2H3.
What are the key properties of N-propyl-1-pyridin-3-yldecan-2-amine?
N-propyl-1-pyridin-3-yldecan-2-amine has a molecular weight of 276.47 g/mol, XLogP of 4.74, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-pyridin-3-yldecan-2-amine is sourced from PubChem (CID 63416378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).